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

C16H25N3 — CID 64520477

IUPACN-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine
SMILESCCCNCc1cc(N(CC2CC2)C2CC2)ccn1
InChIInChI=1S/C16H25N3/c1-2-8-17-11-14-10-16(7-9-18-14)19(15-5-6-15)12-13-3-4-13/h7,9-10,13,15,17H,2-6,8,11-12H2,1H3
InChIKeyFQNSFXSDGWOLCJ-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.96
Rot. Bonds8

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

N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine (PubChem CID 64520477) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine
PubChem CID64520477
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC NameN-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine
SMILESCCCNCc1cc(N(CC2CC2)C2CC2)ccn1
InChIInChI=1S/C16H25N3/c1-2-8-17-11-14-10-16(7-9-18-14)19(15-5-6-15)12-13-3-4-13/h7,9-10,13,15,17H,2-6,8,11-12H2,1H3
InChIKeyFQNSFXSDGWOLCJ-UHFFFAOYSA-N
XLogP2.96
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.96
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-cyclopropyl-N-(cyclopropylmethyl)-2-(ethylaminomethyl)pyridin-4-amine
CID 64520480
N-(cyclopropylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine
CID 55059107
N-(cyclopentylmethyl)-N-methyl-2-(propylaminomethyl)pyridin-4-amine
CID 63656716
4-N-cyclopropyl-4-N-(cyclopropylmethyl)-2-N-propylpyridine-2,4-diamine
CID 113367881
N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine
CID 63655101
N-(cyclopropylmethyl)-N-ethyl-2-[(2-methylpropylamino)methyl]pyridin-4-amine
CID 63940070
N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-(propylaminomethyl)pyridin-4-amine
CID 81248139
N-methyl-N-[2-[[2-(propylaminomethyl)-4-pyridinyl]oxy]ethyl]cyclopropanamine
CID 102740576
N-butyl-N-ethyl-2-(propylaminomethyl)pyridin-4-amine
CID 62286341
N-ethyl-N-(2-methylpropyl)-2-(propylaminomethyl)pyridin-4-amine
CID 55055011
N-propyl-2-(propylaminomethyl)-N-(2,2,2-trifluoroethyl)pyridin-4-amine
CID 62282319
N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)pyridin-2-amine
CID 64520876

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine?
The IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine (CID 64520477) is N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine.
What is the SMILES notation for N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine?
The canonical SMILES for N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine is CCCNCc1cc(N(CC2CC2)C2CC2)ccn1.
What is the InChIKey of N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine?
The InChIKey is FQNSFXSDGWOLCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-2-8-17-11-14-10-16(7-9-18-14)19(15-5-6-15)12-13-3-4-13/h7,9-10,13,15,17H,2-6,8,11-12H2,1H3.
What are the key properties of N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine?
N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine has a molecular weight of 259.40 g/mol, XLogP of 2.96, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(cyclopropylmethyl)-2-(propylaminomethyl)pyridin-4-amine is sourced from PubChem (CID 64520477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).