[1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol

C14H23N3O2 — CID 115454120

IUPAC[1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol
SMILESCC(C)(C)Oc1nc(NCC2(CO)CC2)ccc1N
InChIInChI=1S/C14H23N3O2/c1-13(2,3)19-12-10(15)4-5-11(17-12)16-8-14(9-18)6-7-14/h4-5,18H,6-9,15H2,1-3H3,(H,16,17)
InChIKeySBSGBXJWJRMPQF-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.03
Rot. Bonds5

About [1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol

[1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol (PubChem CID 115454120) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is [1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol
PubChem CID115454120
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name[1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol
SMILESCC(C)(C)Oc1nc(NCC2(CO)CC2)ccc1N
InChIInChI=1S/C14H23N3O2/c1-13(2,3)19-12-10(15)4-5-11(17-12)16-8-14(9-18)6-7-14/h4-5,18H,6-9,15H2,1-3H3,(H,16,17)
InChIKeySBSGBXJWJRMPQF-UHFFFAOYSA-N
XLogP2.03
TPSA80.40 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze [1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol with MolForge

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Related Compounds

3-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]-2-methyloxolan-3-ol
CID 106099652
2-N-ethyl-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 43260941
[4-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]oxan-4-yl]methanol
CID 106296884
6-[(2-methylpropan-2-yl)oxy]-2-N-prop-2-enylpyridine-2,5-diamine
CID 62500488
4-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-3,3-dimethylbutan-1-ol
CID 106140773
3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-2,2-difluoropropan-1-ol
CID 106167469
2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 103460190
2-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]propan-1-ol
CID 43498929
5-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-4,4-dimethylpentan-1-ol
CID 106141303
2-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-N-methylacetamide
CID 43310372
6-[(2-methylpropan-2-yl)oxy]-2-N-(2-methylsulfanylethyl)pyridine-2,5-diamine
CID 63982043
(2S)-2-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-3-methylbutan-1-ol
CID 79248758

Frequently Asked Questions

What is the IUPAC name of [1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol (CID 115454120) is [1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol is CC(C)(C)Oc1nc(NCC2(CO)CC2)ccc1N.
What is the InChIKey of [1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol?
The InChIKey is SBSGBXJWJRMPQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-13(2,3)19-12-10(15)4-5-11(17-12)16-8-14(9-18)6-7-14/h4-5,18H,6-9,15H2,1-3H3,(H,16,17).
What are the key properties of [1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol?
[1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol has a molecular weight of 265.36 g/mol, XLogP of 2.03, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]methyl]cyclopropyl]methanol is sourced from PubChem (CID 115454120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).