4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol

C16H25N3O2 — CID 106120160

IUPAC4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol
SMILESNc1ccc(NCC2CCC(O)CC2)nc1OCC1CC1
InChIInChI=1S/C16H25N3O2/c17-14-7-8-15(19-16(14)21-10-12-1-2-12)18-9-11-3-5-13(20)6-4-11/h7-8,11-13,20H,1-6,9-10,17H2,(H,18,19)
InChIKeyJGQURXAQCSBJEM-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.42
Rot. Bonds6

About 4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol

4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol (PubChem CID 106120160) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is 4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol
PubChem CID106120160
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC Name4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol
SMILESNc1ccc(NCC2CCC(O)CC2)nc1OCC1CC1
InChIInChI=1S/C16H25N3O2/c17-14-7-8-15(19-16(14)21-10-12-1-2-12)18-9-11-3-5-13(20)6-4-11/h7-8,11-13,20H,1-6,9-10,17H2,(H,18,19)
InChIKeyJGQURXAQCSBJEM-UHFFFAOYSA-N
XLogP2.42
TPSA80.40 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-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

1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol
CID 43498896
2-[2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]ethoxy]ethanol
CID 62498443
3-[2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]ethyl]-1,1-dimethylurea
CID 83107212
1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol
CID 106284306
6-(cyclopropylmethoxy)-2-N-(2-pyridin-4-ylethyl)pyridine-2,5-diamine
CID 60914941
6-(cyclopropylmethoxy)-2-N-phenylpyridine-2,5-diamine
CID 43261281
2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-2-ethylbutan-1-ol
CID 62524145
3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol
CID 106099457
6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine
CID 62323028
6-(cyclopropylmethoxy)-2-N-piperidin-1-ylpyridine-2,5-diamine
CID 83005153
6-(cyclopropylmethoxy)-2-N-[(4,5-dimethylthiophen-2-yl)methyl]pyridine-2,5-diamine
CID 65246368
6-(cyclopropylmethoxy)-2-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyridine-2,5-diamine
CID 79223181

Frequently Asked Questions

What is the IUPAC name of 4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol (CID 106120160) is 4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol is Nc1ccc(NCC2CCC(O)CC2)nc1OCC1CC1.
What is the InChIKey of 4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol?
The InChIKey is JGQURXAQCSBJEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c17-14-7-8-15(19-16(14)21-10-12-1-2-12)18-9-11-3-5-13(20)6-4-11/h7-8,11-13,20H,1-6,9-10,17H2,(H,18,19).
What are the key properties of 4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol?
4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol has a molecular weight of 291.39 g/mol, XLogP of 2.42, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 106120160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).