3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine

C12H19N3 — CID 64505159

IUPAC3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine
SMILESCc1ccnc(N)c1CCCNC1CC1
InChIInChI=1S/C12H19N3/c1-9-6-8-15-12(13)11(9)3-2-7-14-10-4-5-10/h6,8,10,14H,2-5,7H2,1H3,(H2,13,15)
InChIKeyUNYWNLKTJVHRDL-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.66
Rot. Bonds5

About 3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine

3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine (PubChem CID 64505159) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine.

Molecular Properties

Compound Name3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine
PubChem CID64505159
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine
SMILESCc1ccnc(N)c1CCCNC1CC1
InChIInChI=1S/C12H19N3/c1-9-6-8-15-12(13)11(9)3-2-7-14-10-4-5-10/h6,8,10,14H,2-5,7H2,1H3,(H2,13,15)
InChIKeyUNYWNLKTJVHRDL-UHFFFAOYSA-N
XLogP1.66
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-pyridin-4-ylpropyl)cyclopropanamine
CID 62549515
N-[3-[4,6-dimethyl-2-(3-methylfuran-2-yl)pyrimidin-5-yl]propyl]cyclopropanamine
CID 104807289
N-[4-(2-methylnaphthalen-1-yl)butyl]cyclopropanamine
CID 81432277
5-chloro-3-[3-(cyclopropylamino)propyl]pyridin-2-amine
CID 64503512
N-[3-(3,5-dimethyl-1-pyrimidin-4-ylpyrazol-4-yl)propyl]cyclopropanamine
CID 79822676
N-[4-(2,4,6-trimethylphenyl)butyl]cyclopentanamine
CID 98017013
N-[6-(3,4-dimethylphenyl)hexyl]cyclopropanamine
CID 65308417
N-[3-(2-cyclopentyl-4,6-dimethylpyrimidin-5-yl)propyl]cyclopropanamine
CID 62745618
N-[3-(4,7-dimethyl-1H-indol-3-yl)propyl]cyclopropanamine
CID 96674667
N-cyclopropyl-N'-methyl-N'-(2-methylpyrimidin-4-yl)ethane-1,2-diamine
CID 62770071
N-[3-[4,6-dimethyl-2-(2-methylcyclopropyl)pyrimidin-5-yl]propyl]cyclopropanamine
CID 65420884
N-[3-[4,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-5-yl]propyl]cyclopropanamine
CID 55113678

Frequently Asked Questions

What is the IUPAC name of 3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine?
The IUPAC name of 3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine (CID 64505159) is 3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine.
What is the SMILES notation for 3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine?
The canonical SMILES for 3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine is Cc1ccnc(N)c1CCCNC1CC1.
What is the InChIKey of 3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine?
The InChIKey is UNYWNLKTJVHRDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-9-6-8-15-12(13)11(9)3-2-7-14-10-4-5-10/h6,8,10,14H,2-5,7H2,1H3,(H2,13,15).
What are the key properties of 3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine?
3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine has a molecular weight of 205.31 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(cyclopropylamino)propyl]-4-methylpyridin-2-amine is sourced from PubChem (CID 64505159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).