3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol

C14H21N3O3 — CID 106099457

IUPAC3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol
SMILESNc1ccc(NCC2(O)CCOC2)nc1OCC1CC1
InChIInChI=1S/C14H21N3O3/c15-11-3-4-12(16-8-14(18)5-6-19-9-14)17-13(11)20-7-10-1-2-10/h3-4,10,18H,1-2,5-9,15H2,(H,16,17)
InChIKeyWQIDQYCCUVWJAD-UHFFFAOYSA-N
MW279.34 g/mol
LogP1.02
Rot. Bonds6

About 3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol

3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol (PubChem CID 106099457) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is 3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol.

Molecular Properties

Compound Name3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol
PubChem CID106099457
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC Name3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol
SMILESNc1ccc(NCC2(O)CCOC2)nc1OCC1CC1
InChIInChI=1S/C14H21N3O3/c15-11-3-4-12(16-8-14(18)5-6-19-9-14)17-13(11)20-7-10-1-2-10/h3-4,10,18H,1-2,5-9,15H2,(H,16,17)
InChIKeyWQIDQYCCUVWJAD-UHFFFAOYSA-N
XLogP1.02
TPSA89.63 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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

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Related Compounds

[4-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]oxan-4-yl]methanol
CID 106296858
4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol
CID 106120160
1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol
CID 43498896
3-[(pyrido[2,3-b]pyrazin-6-ylamino)methyl]oxolan-3-ol
CID 103847712
1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol
CID 106284306
2-[2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]ethoxy]ethanol
CID 62498443
3-[[(5-methyl-2-pyridinyl)amino]methyl]oxolan-3-ol
CID 103847710
6-(cyclopropylmethoxy)-2-N-phenylpyridine-2,5-diamine
CID 43261281
2-(cyclopropylmethoxy)-6-(oxetan-3-ylsulfanyl)pyridin-3-amine
CID 79326045
6-[(3-hydroxyoxolan-3-yl)methylamino]-2-methylpyridine-3-carboxylic acid
CID 114143616
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

Frequently Asked Questions

What is the IUPAC name of 3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol?
The IUPAC name of 3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol (CID 106099457) is 3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol.
What is the SMILES notation for 3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol?
The canonical SMILES for 3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol is Nc1ccc(NCC2(O)CCOC2)nc1OCC1CC1.
What is the InChIKey of 3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol?
The InChIKey is WQIDQYCCUVWJAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c15-11-3-4-12(16-8-14(18)5-6-19-9-14)17-13(11)20-7-10-1-2-10/h3-4,10,18H,1-2,5-9,15H2,(H,16,17).
What are the key properties of 3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol?
3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol has a molecular weight of 279.34 g/mol, XLogP of 1.02, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]oxolan-3-ol is sourced from PubChem (CID 106099457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).