N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine

C17H27N7O — CID 154753697

IUPACN,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine
SMILESCCCn1nnnc1CN1CCC(Oc2ccnc(CN(C)C)c2)C1
InChIInChI=1S/C17H27N7O/c1-4-8-24-17(19-20-21-24)13-23-9-6-16(12-23)25-15-5-7-18-14(10-15)11-22(2)3/h5,7,10,16H,4,6,8-9,11-13H2,1-3H3
InChIKeyRYWMNZGPMHOIRB-UHFFFAOYSA-N
MW345.45 g/mol
LogP1.19
Rot. Bonds8

About N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine

N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine (PubChem CID 154753697) has the molecular formula C17H27N7O and a molecular weight of 345.45 g/mol. Its IUPAC name is N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine
PubChem CID154753697
Molecular FormulaC17H27N7O
Molecular Weight345.45 g/mol
Exact Mass345.23
IUPAC NameN,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine
SMILESCCCn1nnnc1CN1CCC(Oc2ccnc(CN(C)C)c2)C1
InChIInChI=1S/C17H27N7O/c1-4-8-24-17(19-20-21-24)13-23-9-6-16(12-23)25-15-5-7-18-14(10-15)11-22(2)3/h5,7,10,16H,4,6,8-9,11-13H2,1-3H3
InChIKeyRYWMNZGPMHOIRB-UHFFFAOYSA-N
XLogP1.19
TPSA72.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine with MolForge

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Related Compounds

5-[[3-[[2-[(dimethylamino)methyl]-4-pyridinyl]oxy]pyrrolidin-1-yl]methyl]-2-methyl-4H-1,2,4-triazol-3-one
CID 154753698
N,N-dimethyl-1-[4-[1-(2-methyl-3-methylsulfonylpropyl)pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine
CID 154753706
N,N-dimethyl-1-[4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine
CID 154753505
4-(phenoxymethyl)-1-[(1-propyltetrazol-5-yl)methyl]piperidine
CID 86831886
4-[(3S)-1-[(1-cyclopropyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxypyridine
CID 97085016
[3-[[2-[(dimethylamino)methyl]-4-pyridinyl]oxy]pyrrolidin-1-yl]-pyrazin-2-ylmethanone
CID 154761996
3-[(1-propyltetrazol-5-yl)methyl]-3,9-diazabicyclo[4.2.1]nonane
CID 81490223
[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine
CID 62288053
(3R)-3-(methoxymethyl)-1-[(1-propyltetrazol-5-yl)methyl]piperidine
CID 96538871
N-methyl-N-[[4-[1-(6-pyrimidin-2-ylpyrimidin-4-yl)pyrrolidin-3-yl]oxy-2-pyridinyl]methyl]ethanamine
CID 166291698
N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]acetamide
CID 71928326
1-[(1-propyltetrazol-5-yl)methyl]-4-pyrrolidin-2-ylpiperidine
CID 63257316

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine?
The IUPAC name of N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine (CID 154753697) is N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine is CCCn1nnnc1CN1CCC(Oc2ccnc(CN(C)C)c2)C1.
What is the InChIKey of N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine?
The InChIKey is RYWMNZGPMHOIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N7O/c1-4-8-24-17(19-20-21-24)13-23-9-6-16(12-23)25-15-5-7-18-14(10-15)11-22(2)3/h5,7,10,16H,4,6,8-9,11-13H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine?
N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine has a molecular weight of 345.45 g/mol, XLogP of 1.19, 8 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[4-[1-[(1-propyltetrazol-5-yl)methyl]pyrrolidin-3-yl]oxy-2-pyridinyl]methanamine is sourced from PubChem (CID 154753697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).