(1R)-1-cyclopropylbutan-1-amine;hydrochloride

C7H16ClN — CID 155046187

IUPAC(1R)-1-cyclopropylbutan-1-amine;hydrochloride
SMILESCCC[C@@H](N)C1CC1.Cl
InChIInChI=1S/C7H15N.ClH/c1-2-3-7(8)6-4-5-6;/h6-7H,2-5,8H2,1H3;1H/t7-;/m1./s1
InChIKeyPCQIJDFASVMRIS-OGFXRTJISA-N
MW149.66 g/mol
LogP1.95
Rot. Bonds3

About (1R)-1-cyclopropylbutan-1-amine;hydrochloride

(1R)-1-cyclopropylbutan-1-amine;hydrochloride (PubChem CID 155046187) has the molecular formula C7H16ClN and a molecular weight of 149.66 g/mol. Its IUPAC name is (1R)-1-cyclopropylbutan-1-amine;hydrochloride.

Molecular Properties

Compound Name(1R)-1-cyclopropylbutan-1-amine;hydrochloride
PubChem CID155046187
Molecular FormulaC7H16ClN
Molecular Weight149.66 g/mol
Exact Mass149.10
IUPAC Name(1R)-1-cyclopropylbutan-1-amine;hydrochloride
SMILESCCC[C@@H](N)C1CC1.Cl
InChIInChI=1S/C7H15N.ClH/c1-2-3-7(8)6-4-5-6;/h6-7H,2-5,8H2,1H3;1H/t7-;/m1./s1
InChIKeyPCQIJDFASVMRIS-OGFXRTJISA-N
XLogP1.95
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.66
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-1-cyclobutylbutan-1-amine
CID 55293085
azane;1-cyclobutylbutan-1-amine;dihydrate
CID 140660348
1-(3-methylcyclopentyl)butan-1-amine
CID 65414567
1-(1,1-dioxothian-4-yl)butan-1-amine
CID 83048118
1-[4-[(1S)-1-aminoethyl]cyclohexyl]pentan-1-amine
CID 144564960
1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butan-1-amine
CID 112680991
(1S)-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butan-1-amine
CID 104932359
1-(oxolan-3-yl)butan-1-amine
CID 63564938
(1R)-1-cyclopentylpentan-1-amine
CID 55292231
1-(oxolan-3-yl)butan-1-amine;hydrate
CID 174673469
1-cyclopropyl-N',N'-diethylbutane-1,4-diamine;dihydrochloride
CID 69456061
1-(4-ethylcyclohexyl)undecan-1-amine
CID 65394557

Frequently Asked Questions

What is the IUPAC name of (1R)-1-cyclopropylbutan-1-amine;hydrochloride?
The IUPAC name of (1R)-1-cyclopropylbutan-1-amine;hydrochloride (CID 155046187) is (1R)-1-cyclopropylbutan-1-amine;hydrochloride.
What is the SMILES notation for (1R)-1-cyclopropylbutan-1-amine;hydrochloride?
The canonical SMILES for (1R)-1-cyclopropylbutan-1-amine;hydrochloride is CCC[C@@H](N)C1CC1.Cl.
What is the InChIKey of (1R)-1-cyclopropylbutan-1-amine;hydrochloride?
The InChIKey is PCQIJDFASVMRIS-OGFXRTJISA-N. The full InChI is InChI=1S/C7H15N.ClH/c1-2-3-7(8)6-4-5-6;/h6-7H,2-5,8H2,1H3;1H/t7-;/m1./s1.
What are the key properties of (1R)-1-cyclopropylbutan-1-amine;hydrochloride?
(1R)-1-cyclopropylbutan-1-amine;hydrochloride has a molecular weight of 149.66 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-cyclopropylbutan-1-amine;hydrochloride is sourced from PubChem (CID 155046187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).