N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine

C17H29N5O — CID 68513308

IUPACN-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine
SMILESCN(CCCN1CCOCC1)c1ccc(N2CCNCC2)cn1
InChIInChI=1S/C17H29N5O/c1-20(7-2-8-21-11-13-23-14-12-21)17-4-3-16(15-19-17)22-9-5-18-6-10-22/h3-4,15,18H,2,5-14H2,1H3
InChIKeyAZAGECGEFLWBIJ-UHFFFAOYSA-N
MW319.45 g/mol
LogP0.65
Rot. Bonds6

About N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine

N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine (PubChem CID 68513308) has the molecular formula C17H29N5O and a molecular weight of 319.45 g/mol. Its IUPAC name is N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine.

Molecular Properties

Compound NameN-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine
PubChem CID68513308
Molecular FormulaC17H29N5O
Molecular Weight319.45 g/mol
Exact Mass319.24
IUPAC NameN-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine
SMILESCN(CCCN1CCOCC1)c1ccc(N2CCNCC2)cn1
InChIInChI=1S/C17H29N5O/c1-20(7-2-8-21-11-13-23-14-12-21)17-4-3-16(15-19-17)22-9-5-18-6-10-22/h3-4,15,18H,2,5-14H2,1H3
InChIKeyAZAGECGEFLWBIJ-UHFFFAOYSA-N
XLogP0.65
TPSA43.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.45
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-bromo-N-methyl-N-(3-morpholin-4-ylpropyl)pyridin-2-amine
CID 68556749
N-methyl-N-(3-morpholin-4-ylpropyl)-6-piperazin-1-ylpyridin-2-amine
CID 68559270
N,N-dimethyl-5-piperazin-1-ylpyridin-2-amine
CID 152925430
N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine
CID 115230516
2-N-methyl-2-N-(2-morpholin-4-ylethyl)pyridine-2,5-diamine
CID 59225426
4-[2-(4-piperazin-1-ylphenoxy)ethyl]morpholine
CID 43510321
N-methyl-5-nitro-N-(2-piperazin-1-ylethyl)pyridin-2-amine
CID 63266171
N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-4-amine
CID 115230518
N-methyl-N-(2-piperazin-1-ylethyl)pyrimidin-4-amine
CID 63266299
ethane;4-(2-piperazin-1-ylethyl)morpholine
CID 143985030
2-N,2-N,4-N-trimethyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 75422017
N,N-dimethyl-1-[4-(morpholin-4-ylmethyl)phenyl]-2-[(4-piperazin-1-ylphenyl)methyl]butan-2-amine
CID 146184027

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine?
The IUPAC name of N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine (CID 68513308) is N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine.
What is the SMILES notation for N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine?
The canonical SMILES for N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine is CN(CCCN1CCOCC1)c1ccc(N2CCNCC2)cn1.
What is the InChIKey of N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine?
The InChIKey is AZAGECGEFLWBIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N5O/c1-20(7-2-8-21-11-13-23-14-12-21)17-4-3-16(15-19-17)22-9-5-18-6-10-22/h3-4,15,18H,2,5-14H2,1H3.
What are the key properties of N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine?
N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine has a molecular weight of 319.45 g/mol, XLogP of 0.65, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine is sourced from PubChem (CID 68513308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).