N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine

C14H23N3 — CID 55059107

IUPACN-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine
SMILESCCCNCc1cc(N(C)CC2CC2)ccn1
InChIInChI=1S/C14H23N3/c1-3-7-15-10-13-9-14(6-8-16-13)17(2)11-12-4-5-12/h6,8-9,12,15H,3-5,7,10-11H2,1-2H3
InChIKeyVFBOTLDRMXMAKZ-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.43
Rot. Bonds7

About N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine

N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine (PubChem CID 55059107) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine
PubChem CID55059107
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine
SMILESCCCNCc1cc(N(C)CC2CC2)ccn1
InChIInChI=1S/C14H23N3/c1-3-7-15-10-13-9-14(6-8-16-13)17(2)11-12-4-5-12/h6,8-9,12,15H,3-5,7,10-11H2,1-2H3
InChIKeyVFBOTLDRMXMAKZ-UHFFFAOYSA-N
XLogP2.43
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(cyclopentylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine
CID 63656716
N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine
CID 64520477
N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine
CID 63655101
N-cyclopropyl-N-(cyclopropylmethyl)-2-(ethylaminomethyl)pyridin-4-amine
CID 64520480
N-methyl-N-(oxan-4-ylmethyl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 63707826
N-(cyclopropylmethyl)-N-methyl-3-(propylaminomethyl)pyridin-2-amine
CID 62284189
N-(cyclopropylmethyl)-N-methyl-3-(propylaminomethyl)isoquinolin-1-amine
CID 62282803
N-(cyclopropylmethyl)-N-ethyl-2-[(2-methylpropylamino)methyl]pyridin-4-amine
CID 63940070
N-butyl-N-ethyl-2-(propylaminomethyl)pyridin-4-amine
CID 62286341
N-methyl-N-[(2-methylcyclopropyl)methyl]-2-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 63865437
N-ethyl-N-(2-methylpropyl)-2-(propylaminomethyl)pyridin-4-amine
CID 55055011
2-chloro-N-(cyclobutylmethyl)-N-methylpyridin-4-amine
CID 103756840

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine?
The IUPAC name of N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine (CID 55059107) is N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine?
The canonical SMILES for N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine is CCCNCc1cc(N(C)CC2CC2)ccn1.
What is the InChIKey of N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine?
The InChIKey is VFBOTLDRMXMAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-7-15-10-13-9-14(6-8-16-13)17(2)11-12-4-5-12/h6,8-9,12,15H,3-5,7,10-11H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine?
N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine has a molecular weight of 233.36 g/mol, XLogP of 2.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine is sourced from PubChem (CID 55059107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).