N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine

C13H27N3 — CID 81465521

IUPACN,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine
SMILESCC1CN(C2CCNCC2C)CC1N(C)C
InChIInChI=1S/C13H27N3/c1-10-7-14-6-5-12(10)16-8-11(2)13(9-16)15(3)4/h10-14H,5-9H2,1-4H3
InChIKeyMJTVMALKMGMBBX-UHFFFAOYSA-N
MW225.38 g/mol
LogP0.87
Rot. Bonds2

About N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine

N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine (PubChem CID 81465521) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine
PubChem CID81465521
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC NameN,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine
SMILESCC1CN(C2CCNCC2C)CC1N(C)C
InChIInChI=1S/C13H27N3/c1-10-7-14-6-5-12(10)16-8-11(2)13(9-16)15(3)4/h10-14H,5-9H2,1-4H3
InChIKeyMJTVMALKMGMBBX-UHFFFAOYSA-N
XLogP0.87
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3,4-dimethoxypyrrolidin-1-yl)-3-methylpiperidine
CID 103534210
(3R,4S)-3-methyl-4-pyrrolidin-1-ylpiperidine
CID 67315323
(3S,4R)-3-methyl-4-pyrrolidin-1-ylpiperidine;dihydrochloride
CID 67315320
3-methyl-4-piperidin-1-ylpiperidine
CID 18457680
N,N-dimethyl-1-(4-methylpiperidin-3-yl)piperidin-4-amine
CID 66271353
N,N-dimethyl-1-(4-methylpyrrolidin-3-yl)pyrrolidin-3-amine
CID 81458935
N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine
CID 81464634
2,3,5-trimethyl-1-(3-methylpiperidin-4-yl)piperidine
CID 114593551
N,N,4-trimethyl-1-(2-piperidin-3-ylethyl)pyrrolidin-3-amine
CID 81463747
(4S)-N,N,4-trimethylpyrrolidin-3-amine
CID 142439406
4-[4-(3-methylpiperidin-4-yl)piperazin-1-yl]benzonitrile
CID 70060153
4-[4-[(3R,4S)-3-methylpiperidin-4-yl]piperazin-1-yl]benzonitrile
CID 70060159

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine?
The IUPAC name of N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine (CID 81465521) is N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine.
What is the SMILES notation for N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine?
The canonical SMILES for N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine is CC1CN(C2CCNCC2C)CC1N(C)C.
What is the InChIKey of N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine?
The InChIKey is MJTVMALKMGMBBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-10-7-14-6-5-12(10)16-8-11(2)13(9-16)15(3)4/h10-14H,5-9H2,1-4H3.
What are the key properties of N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine?
N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine has a molecular weight of 225.38 g/mol, XLogP of 0.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-1-(3-methylpiperidin-4-yl)pyrrolidin-3-amine is sourced from PubChem (CID 81465521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).