2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol

C12H18N2O — CID 61055830

IUPAC2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol
SMILESCC(CO)(NCC1CC1)c1ccncc1
InChIInChI=1S/C12H18N2O/c1-12(9-15,14-8-10-2-3-10)11-4-6-13-7-5-11/h4-7,10,14-15H,2-3,8-9H2,1H3
InChIKeyLNOPRCLYJDEQOV-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.29
Rot. Bonds5

About 2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol

2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol (PubChem CID 61055830) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol
PubChem CID61055830
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol
SMILESCC(CO)(NCC1CC1)c1ccncc1
InChIInChI=1S/C12H18N2O/c1-12(9-15,14-8-10-2-3-10)11-4-6-13-7-5-11/h4-7,10,14-15H,2-3,8-9H2,1H3
InChIKeyLNOPRCLYJDEQOV-UHFFFAOYSA-N
XLogP1.29
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(1-methylpiperidin-3-yl)methylamino]-2-phenylpropan-1-ol
CID 105057805
4-[(pyridin-4-ylamino)methyl]cyclohexan-1-ol
CID 106130739
2-(cyclopropylmethylamino)-2-pyridin-3-ylpropanoic acid
CID 61002220
2-(cyclopropylmethylamino)-2-phenylbutan-1-ol
CID 61054828
1-cyclopropyl-N-(pyridin-4-ylmethyl)methanamine;hydrochloride
CID 167733766
N-[[4-(methylamino)cyclohexyl]methyl]pyridin-4-amine
CID 115213590
2-(cyclopropylmethylamino)-2-methylbutan-1-ol
CID 61054003
(1R)-1-cyclopropyl-1-pyridin-4-ylethanol
CID 124746902
2-(hydroxymethyl)-2-pyridin-4-ylpropane-1,3-diol
CID 19707525
2-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-2-phenylpropan-1-ol
CID 115685647
methyl 2-(cyclopropylmethylamino)-2-[4-(trifluoromethyl)phenyl]propanoate
CID 61002805
N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyridin-4-ylacetamide
CID 105059171

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol?
The IUPAC name of 2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol (CID 61055830) is 2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol.
What is the SMILES notation for 2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol?
The canonical SMILES for 2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol is CC(CO)(NCC1CC1)c1ccncc1.
What is the InChIKey of 2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol?
The InChIKey is LNOPRCLYJDEQOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-12(9-15,14-8-10-2-3-10)11-4-6-13-7-5-11/h4-7,10,14-15H,2-3,8-9H2,1H3.
What are the key properties of 2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol?
2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol has a molecular weight of 206.29 g/mol, XLogP of 1.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-2-pyridin-4-ylpropan-1-ol is sourced from PubChem (CID 61055830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).