N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine

C16H25N3 — CID 55059068

IUPACN-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine
SMILESCC(C)CN(c1cc(CNC2CC2)ccn1)C1CC1
InChIInChI=1S/C16H25N3/c1-12(2)11-19(15-5-6-15)16-9-13(7-8-17-16)10-18-14-3-4-14/h7-9,12,14-15,18H,3-6,10-11H2,1-2H3
InChIKeyCUXLJIJMSLOUPM-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.96
Rot. Bonds7

About N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine

N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine (PubChem CID 55059068) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine
PubChem CID55059068
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC NameN-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine
SMILESCC(C)CN(c1cc(CNC2CC2)ccn1)C1CC1
InChIInChI=1S/C16H25N3/c1-12(2)11-19(15-5-6-15)16-9-13(7-8-17-16)10-18-14-3-4-14/h7-9,12,14-15,18H,3-6,10-11H2,1-2H3
InChIKeyCUXLJIJMSLOUPM-UHFFFAOYSA-N
XLogP2.96
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
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

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Related Compounds

N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)aniline
CID 55002084
N-cyclopropyl-4-[(2-methylpropylamino)methyl]-N-(2,2,2-trifluoroethyl)pyridin-2-amine
CID 62282660
N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-4-amine
CID 81246811
4-[(cyclopropylamino)methyl]-N-(4-fluorophenyl)-N-methylpyridin-2-amine
CID 62292831
N-[[2-[1-(dimethylamino)propan-2-yloxy]-4-pyridinyl]methyl]cyclopropanamine
CID 112741471
N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylaminomethyl)pyridin-2-amine
CID 64520876
4-[(cyclopropylamino)methyl]-N-(3-methoxypropyl)-N-methylpyridin-2-amine
CID 55139542
N-cyclopentyl-N-ethyl-4-(ethylaminomethyl)pyridin-2-amine
CID 62280816
N-cyclopentyl-N-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62280559
4-[(2-methyl-4-pyridinyl)methylamino]cyclohexan-1-ol
CID 23396980
N-[[2-(4-propan-2-ylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine
CID 62283972
4-[(cyclopropylamino)methyl]pyridine-2-carbaldehyde
CID 90375224

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine?
The IUPAC name of N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine (CID 55059068) is N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine.
What is the SMILES notation for N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine?
The canonical SMILES for N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine is CC(C)CN(c1cc(CNC2CC2)ccn1)C1CC1.
What is the InChIKey of N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine?
The InChIKey is CUXLJIJMSLOUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-12(2)11-19(15-5-6-15)16-9-13(7-8-17-16)10-18-14-3-4-14/h7-9,12,14-15,18H,3-6,10-11H2,1-2H3.
What are the key properties of N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine?
N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine has a molecular weight of 259.40 g/mol, XLogP of 2.96, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-2-amine is sourced from PubChem (CID 55059068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).