1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine

C14H28N2 — CID 115718359

IUPAC1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine
SMILESCC(C)CC(C)NC1CCN(CC2CC2)C1
InChIInChI=1S/C14H28N2/c1-11(2)8-12(3)15-14-6-7-16(10-14)9-13-4-5-13/h11-15H,4-10H2,1-3H3
InChIKeyXDSIFOUNUGCTNK-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.49
Rot. Bonds6

About 1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine

1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine (PubChem CID 115718359) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine
PubChem CID115718359
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine
SMILESCC(C)CC(C)NC1CCN(CC2CC2)C1
InChIInChI=1S/C14H28N2/c1-11(2)8-12(3)15-14-6-7-16(10-14)9-13-4-5-13/h11-15H,4-10H2,1-3H3
InChIKeyXDSIFOUNUGCTNK-UHFFFAOYSA-N
XLogP2.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclopropylmethyl)-N-pentan-2-ylpiperidin-4-amine
CID 115704112
1-ethyl-N-(4-methylpentan-2-yl)piperidin-3-amine
CID 61169975
2-[[1-(cyclopropylmethyl)piperidin-4-yl]amino]propan-1-ol
CID 115724726
N-(4-methylpentan-2-yl)-1-prop-2-enylpiperidin-4-amine
CID 115717902
N-(4-methylpentan-2-yl)-1-propan-2-ylpiperidin-4-amine
CID 43206641
(3S)-1-(2-methylpropyl)-N-propan-2-ylpyrrolidin-3-amine
CID 164836687
N-(4-methylpentan-2-yl)cyclohexanamine
CID 21355503
(3S)-1-(cyclopropylmethyl)-N-(oxan-4-yl)pyrrolidin-3-amine
CID 97068723
1-(cyclopropylmethyl)-3-methylpyrrolidine
CID 66698418
N-butan-2-yl-1-ethylpiperidin-4-amine
CID 43177306
2-[[1-(cyclopropylmethyl)piperidin-4-yl]amino]propane-1,3-diol
CID 115724142
(2R)-2-[[4-(cyclopropylmethyl)piperazine-1-carbonyl]amino]-4-methylpentanoic acid
CID 78976051

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine?
The IUPAC name of 1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine (CID 115718359) is 1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine.
What is the SMILES notation for 1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine?
The canonical SMILES for 1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine is CC(C)CC(C)NC1CCN(CC2CC2)C1.
What is the InChIKey of 1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine?
The InChIKey is XDSIFOUNUGCTNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-11(2)8-12(3)15-14-6-7-16(10-14)9-13-4-5-13/h11-15H,4-10H2,1-3H3.
What are the key properties of 1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine?
1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine has a molecular weight of 224.39 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-N-(4-methylpentan-2-yl)pyrrolidin-3-amine is sourced from PubChem (CID 115718359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).