2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol

C14H29NO — CID 65234410

IUPAC2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol
SMILESCCNC1(CCO)CCCC(C(C)C)CC1
InChIInChI=1S/C14H29NO/c1-4-15-14(10-11-16)8-5-6-13(7-9-14)12(2)3/h12-13,15-16H,4-11H2,1-3H3
InChIKeyOAIKQOMERHVUNB-UHFFFAOYSA-N
MW227.39 g/mol
LogP2.95
Rot. Bonds5

About 2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol

2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol (PubChem CID 65234410) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol.

Molecular Properties

Compound Name2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol
PubChem CID65234410
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol
SMILESCCNC1(CCO)CCCC(C(C)C)CC1
InChIInChI=1S/C14H29NO/c1-4-15-14(10-11-16)8-5-6-13(7-9-14)12(2)3/h12-13,15-16H,4-11H2,1-3H3
InChIKeyOAIKQOMERHVUNB-UHFFFAOYSA-N
XLogP2.95
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(ethylamino)-4-methylcycloheptyl]ethanol
CID 65234993
1-(aminomethyl)-N-ethyl-4-propan-2-ylcycloheptan-1-amine
CID 65089340
2-[1-(ethylamino)cyclopentyl]ethanol
CID 64982680
2-[1-(ethylamino)cyclohexyl]ethanol
CID 64989011
2-[4-(ethylamino)-1-propan-2-ylazepan-4-yl]ethanol
CID 65235226
3-[[1-(aminomethyl)-4-propan-2-ylcycloheptyl]amino]propan-1-ol
CID 65377199
2-(1-amino-4-propan-2-ylcycloheptyl)ethanol
CID 65240022
[1-(benzylamino)-4-propan-2-ylcycloheptyl]methanol
CID 65090266
(1-anilino-4-propan-2-ylcycloheptyl)methanol
CID 65090420
3-[[1-(aminomethyl)-3-propan-2-ylcyclohexyl]amino]propan-1-ol
CID 107449168
2-[1-[(1-cyclopentylethylamino)methyl]cyclobutyl]ethanol
CID 115894754
[1-(cyclopropylamino)-3-propan-2-ylcyclohexyl]methanol
CID 107450341

Frequently Asked Questions

What is the IUPAC name of 2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol?
The IUPAC name of 2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol (CID 65234410) is 2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol.
What is the SMILES notation for 2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol?
The canonical SMILES for 2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol is CCNC1(CCO)CCCC(C(C)C)CC1.
What is the InChIKey of 2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol?
The InChIKey is OAIKQOMERHVUNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-4-15-14(10-11-16)8-5-6-13(7-9-14)12(2)3/h12-13,15-16H,4-11H2,1-3H3.
What are the key properties of 2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol?
2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol has a molecular weight of 227.39 g/mol, XLogP of 2.95, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(ethylamino)-4-propan-2-ylcycloheptyl]ethanol is sourced from PubChem (CID 65234410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).