[2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol

C15H31N3O — CID 106359944

IUPAC[2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol
SMILESCC(C)N1CCC(CN)(NC2CCCC2CO)CC1
InChIInChI=1S/C15H31N3O/c1-12(2)18-8-6-15(11-16,7-9-18)17-14-5-3-4-13(14)10-19/h12-14,17,19H,3-11,16H2,1-2H3
InChIKeyQQJWMFYIRMCPOU-UHFFFAOYSA-N
MW269.43 g/mol
LogP0.94
Rot. Bonds5

About [2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol

[2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol (PubChem CID 106359944) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is [2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol
PubChem CID106359944
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name[2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol
SMILESCC(C)N1CCC(CN)(NC2CCCC2CO)CC1
InChIInChI=1S/C15H31N3O/c1-12(2)18-8-6-15(11-16,7-9-18)17-14-5-3-4-13(14)10-19/h12-14,17,19H,3-11,16H2,1-2H3
InChIKeyQQJWMFYIRMCPOU-UHFFFAOYSA-N
XLogP0.94
TPSA61.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[[4-(aminomethyl)-1-(2-methylpropyl)piperidin-4-yl]amino]cyclohexyl]methanol
CID 106360413
[2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol
CID 106360313
[2-[[7-(aminomethyl)-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-yl]amino]cyclopentyl]methanol
CID 106360020
[2-[[1-(aminomethyl)-3,5-dimethylcyclohexyl]amino]cyclopentyl]methanol
CID 106359954
4-(aminomethyl)-N-(cyclopropylmethyl)-1-propan-2-ylpiperidin-4-amine
CID 65384386
[2-[[3-(aminomethyl)oxolan-3-yl]amino]cyclohexyl]methanol
CID 106360446
4-(aminomethyl)-N-(oxolan-2-ylmethyl)-1-propan-2-ylpiperidin-4-amine
CID 65378603
[2-[[1-(aminomethyl)-3-cyclopropylcyclohexyl]amino]cyclohexyl]methanol
CID 106360376
[2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol
CID 114178587
[2-[[3-(aminomethyl)-2-methylthiolan-3-yl]amino]cyclohexyl]methanol
CID 114178599
3-[[2-(hydroxymethyl)cyclopentyl]amino]-2-methylpropan-1-ol
CID 106360784
[4-(oxolan-2-ylmethylamino)-1-propan-2-ylpiperidin-4-yl]methanol
CID 61047764

Frequently Asked Questions

What is the IUPAC name of [2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol?
The IUPAC name of [2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol (CID 106359944) is [2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol.
What is the SMILES notation for [2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol?
The canonical SMILES for [2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol is CC(C)N1CCC(CN)(NC2CCCC2CO)CC1.
What is the InChIKey of [2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol?
The InChIKey is QQJWMFYIRMCPOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-12(2)18-8-6-15(11-16,7-9-18)17-14-5-3-4-13(14)10-19/h12-14,17,19H,3-11,16H2,1-2H3.
What are the key properties of [2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol?
[2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol has a molecular weight of 269.43 g/mol, XLogP of 0.94, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol is sourced from PubChem (CID 106359944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).