N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine

C17H33N — CID 64917545

IUPACN-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
SMILESCCC(NC1CCC(C(C)(C)CC)CC1)C1CC1
InChIInChI=1S/C17H33N/c1-5-16(13-7-8-13)18-15-11-9-14(10-12-15)17(3,4)6-2/h13-16,18H,5-12H2,1-4H3
InChIKeyUATRXOSDYNMEJZ-UHFFFAOYSA-N
MW251.46 g/mol
LogP4.76
Rot. Bonds6

About N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine

N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine (PubChem CID 64917545) has the molecular formula C17H33N and a molecular weight of 251.46 g/mol. Its IUPAC name is N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
PubChem CID64917545
Molecular FormulaC17H33N
Molecular Weight251.46 g/mol
Exact Mass251.26
IUPAC NameN-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
SMILESCCC(NC1CCC(C(C)(C)CC)CC1)C1CC1
InChIInChI=1S/C17H33N/c1-5-16(13-7-8-13)18-15-11-9-14(10-12-15)17(3,4)6-2/h13-16,18H,5-12H2,1-4H3
InChIKeyUATRXOSDYNMEJZ-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.46
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(1-cyclobutylpropyl)cyclopropanamine
CID 83682011
4-(2-methylbutan-2-yl)-N-(2-methylpentan-3-yl)cyclohexan-1-amine
CID 43778905
N-[(1R)-1-cyclopentylethyl]-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 81396402
2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]butan-1-ol
CID 43079522
1-(1-bromopropyl)-4-(2-methylbutan-2-yl)cyclohexane
CID 79308508
N-heptan-4-yl-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 43672319
tert-butyl N-[4-(1-cyclopropylpropylamino)cyclohexyl]carbamate
CID 103785661
N-but-3-yn-2-yl-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 114415159
N-(3-methoxybutan-2-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 113481634
N-hexan-2-yl-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 43778904
methyl 3-methyl-2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]pentanoate
CID 43732303
4-N-(1-cyclohexylpropyl)cyclohexane-1,4-diamine
CID 79741042

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine?
The IUPAC name of N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine (CID 64917545) is N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine.
What is the SMILES notation for N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine?
The canonical SMILES for N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine is CCC(NC1CCC(C(C)(C)CC)CC1)C1CC1.
What is the InChIKey of N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine?
The InChIKey is UATRXOSDYNMEJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N/c1-5-16(13-7-8-13)18-15-11-9-14(10-12-15)17(3,4)6-2/h13-16,18H,5-12H2,1-4H3.
What are the key properties of N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine?
N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine has a molecular weight of 251.46 g/mol, XLogP of 4.76, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine is sourced from PubChem (CID 64917545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).