1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol

C16H27N3O2 — CID 106284306

IUPAC1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol
SMILESCCC(CC)C(O)CNc1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C16H27N3O2/c1-3-12(4-2)14(20)9-18-15-8-7-13(17)16(19-15)21-10-11-5-6-11/h7-8,11-12,14,20H,3-6,9-10,17H2,1-2H3,(H,18,19)
InChIKeyQRWPQBPGEAGIGV-UHFFFAOYSA-N
MW293.41 g/mol
LogP2.66
Rot. Bonds9

About 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol

1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol (PubChem CID 106284306) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol.

Molecular Properties

Compound Name1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol
PubChem CID106284306
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC Name1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol
SMILESCCC(CC)C(O)CNc1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C16H27N3O2/c1-3-12(4-2)14(20)9-18-15-8-7-13(17)16(19-15)21-10-11-5-6-11/h7-8,11-12,14,20H,3-6,9-10,17H2,1-2H3,(H,18,19)
InChIKeyQRWPQBPGEAGIGV-UHFFFAOYSA-N
XLogP2.66
TPSA80.40 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol with MolForge

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Related Compounds

1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol
CID 43498896
4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol
CID 106120160
2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-2-ethylbutan-1-ol
CID 62524145
6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine
CID 62323028
2-[(5-amino-6-propoxy-2-pyridinyl)amino]-1-cyclopropylethanol
CID 55172554
2-[2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]ethoxy]ethanol
CID 62498443
6-(cyclopropylmethoxy)-2-N-phenylpyridine-2,5-diamine
CID 43261281
3-[2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]ethyl]-1,1-dimethylurea
CID 83107212
3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol
CID 106099457
6-(cyclopropylmethoxy)-2-N-(2-pyridin-4-ylethyl)pyridine-2,5-diamine
CID 60914941
6-(cyclopropylmethoxy)-2-N-[(4,5-dimethylthiophen-2-yl)methyl]pyridine-2,5-diamine
CID 65246368
2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-N-ethyl-N-methylpropanamide
CID 103106685

Frequently Asked Questions

What is the IUPAC name of 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol?
The IUPAC name of 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol (CID 106284306) is 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol.
What is the SMILES notation for 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol?
The canonical SMILES for 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol is CCC(CC)C(O)CNc1ccc(N)c(OCC2CC2)n1.
What is the InChIKey of 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol?
The InChIKey is QRWPQBPGEAGIGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2/c1-3-12(4-2)14(20)9-18-15-8-7-13(17)16(19-15)21-10-11-5-6-11/h7-8,11-12,14,20H,3-6,9-10,17H2,1-2H3,(H,18,19).
What are the key properties of 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol?
1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol has a molecular weight of 293.41 g/mol, XLogP of 2.66, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol is sourced from PubChem (CID 106284306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).