(1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine

C10H21N — CID 166781329

IUPAC(1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine
SMILESCC[C@@H](C1CC1)N(C)C(C)C
InChIInChI=1S/C10H21N/c1-5-10(9-6-7-9)11(4)8(2)3/h8-10H,5-7H2,1-4H3/t10-/m0/s1
InChIKeyRFBHRBHCVBPAPC-JTQLQIEISA-N
MW155.28 g/mol
LogP2.52
Rot. Bonds4

About (1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine

(1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine (PubChem CID 166781329) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is (1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name(1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine
PubChem CID166781329
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name(1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine
SMILESCC[C@@H](C1CC1)N(C)C(C)C
InChIInChI=1S/C10H21N/c1-5-10(9-6-7-9)11(4)8(2)3/h8-10H,5-7H2,1-4H3/t10-/m0/s1
InChIKeyRFBHRBHCVBPAPC-JTQLQIEISA-N
XLogP2.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopropyl-N-methyl-N-propan-2-ylethane-1,2-diamine
CID 43654990
4-[1-(dimethylamino)propyl]-N-methylcyclohexan-1-amine
CID 116907222
1-cyclopropyl-N-methyl-N-(2-methylpentan-3-yl)ethane-1,2-diamine
CID 116651334
1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-N-methylethane-1,2-diamine
CID 116651488
4-(1-iodopropyl)-N,N-dimethylcyclohexan-1-amine
CID 142071347
1-cyclopropyl-N-methyl-N-(1-methylsulfanylpropan-2-yl)ethane-1,2-diamine
CID 112658627
(2R)-3-cyclopropyl-N,N-dimethylpentan-2-amine
CID 170184143
N'-(1-cyclopropylpropyl)-N',2,2-trimethylpropane-1,3-diamine
CID 79651995
1-cyclopropyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106603245
(2R)-4-ethyl-N-methyl-N-propan-2-ylhexan-2-amine
CID 89150856
N-methyl-N-[1-(3-methylcyclopentyl)ethyl]propan-2-amine
CID 90905067
1-cyclopropyl-N-ethyl-N-methylethanamine
CID 126664134

Frequently Asked Questions

What is the IUPAC name of (1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine?
The IUPAC name of (1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine (CID 166781329) is (1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for (1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine?
The canonical SMILES for (1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine is CC[C@@H](C1CC1)N(C)C(C)C.
What is the InChIKey of (1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine?
The InChIKey is RFBHRBHCVBPAPC-JTQLQIEISA-N. The full InChI is InChI=1S/C10H21N/c1-5-10(9-6-7-9)11(4)8(2)3/h8-10H,5-7H2,1-4H3/t10-/m0/s1.
What are the key properties of (1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine?
(1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.52, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-cyclopropyl-N-methyl-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 166781329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).