[2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol

C13H24N4O — CID 114178568

IUPAC[2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol
SMILESCCn1cc(C(CN)NC2CCCC2CO)cn1
InChIInChI=1S/C13H24N4O/c1-2-17-8-11(7-15-17)13(6-14)16-12-5-3-4-10(12)9-18/h7-8,10,12-13,16,18H,2-6,9,14H2,1H3
InChIKeyVJYQEMSUYWHSQO-UHFFFAOYSA-N
MW252.36 g/mol
LogP0.65
Rot. Bonds6

About [2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol

[2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol (PubChem CID 114178568) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is [2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol
PubChem CID114178568
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name[2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol
SMILESCCn1cc(C(CN)NC2CCCC2CO)cn1
InChIInChI=1S/C13H24N4O/c1-2-17-8-11(7-15-17)13(6-14)16-12-5-3-4-10(12)9-18/h7-8,10,12-13,16,18H,2-6,9,14H2,1H3
InChIKeyVJYQEMSUYWHSQO-UHFFFAOYSA-N
XLogP0.65
TPSA76.10 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentyl-1-(1-ethylpyrazol-4-yl)ethane-1,2-diamine
CID 103569652
[2-[(1-ethylpyrazol-4-yl)methylamino]cyclopentyl]methanol
CID 115655039
[2-[[2-amino-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]cyclohexyl]methanol
CID 106360448
[2-[[2-amino-1-(3,4,5-trifluorophenyl)ethyl]amino]cyclopentyl]methanol
CID 106360126
[2-[[2-amino-1-[4-(2-methylpropyl)phenyl]ethyl]amino]cyclopentyl]methanol
CID 106359978
[2-[[2-amino-1-(3-tert-butyl-1-methylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol
CID 106359996
2-amino-1-(1-ethylpyrazol-4-yl)ethanol
CID 55264385
2-cyclobutyl-1-(1-ethylpyrazol-4-yl)-N-methylethanamine
CID 103168314
[2-(1-phenylpropylamino)cyclohexyl]methanol
CID 113261894
[2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol
CID 106360158
[2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol
CID 114178543
[2-[(2-amino-1-naphthalen-1-ylethyl)amino]cyclopentyl]methanol
CID 106360045

Frequently Asked Questions

What is the IUPAC name of [2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol?
The IUPAC name of [2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol (CID 114178568) is [2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol.
What is the SMILES notation for [2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol?
The canonical SMILES for [2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol is CCn1cc(C(CN)NC2CCCC2CO)cn1.
What is the InChIKey of [2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol?
The InChIKey is VJYQEMSUYWHSQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-2-17-8-11(7-15-17)13(6-14)16-12-5-3-4-10(12)9-18/h7-8,10,12-13,16,18H,2-6,9,14H2,1H3.
What are the key properties of [2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol?
[2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol has a molecular weight of 252.36 g/mol, XLogP of 0.65, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol is sourced from PubChem (CID 114178568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).