1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine

C13H20N2S — CID 115618481

IUPAC1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine
SMILESc1csc(CNC2CCN(CC3CC3)C2)c1
InChIInChI=1S/C13H20N2S/c1-2-13(16-7-1)8-14-12-5-6-15(10-12)9-11-3-4-11/h1-2,7,11-12,14H,3-6,8-10H2
InChIKeyDUWUMXRODZACGF-UHFFFAOYSA-N
MW236.38 g/mol
LogP2.32
Rot. Bonds5

About 1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine

1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine (PubChem CID 115618481) has the molecular formula C13H20N2S and a molecular weight of 236.38 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine
PubChem CID115618481
Molecular FormulaC13H20N2S
Molecular Weight236.38 g/mol
Exact Mass236.13
IUPAC Name1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine
SMILESc1csc(CNC2CCN(CC3CC3)C2)c1
InChIInChI=1S/C13H20N2S/c1-2-13(16-7-1)8-14-12-5-6-15(10-12)9-11-3-4-11/h1-2,7,11-12,14H,3-6,8-10H2
InChIKeyDUWUMXRODZACGF-UHFFFAOYSA-N
XLogP2.32
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.38
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-N-(thiophen-2-ylmethyl)piperidin-4-amine
CID 4846950
1-prop-2-enyl-N-(thiophen-2-ylmethyl)piperidin-4-amine;hydrochloride
CID 115616309
1-benzyl-N-(thiophen-2-ylmethyl)piperidin-3-amine
CID 43327642
1-(3-methylbut-2-enyl)-N-(thiophen-2-ylmethyl)piperidin-4-amine
CID 43769320
N-methyl-1-(thiophen-2-ylmethyl)pyrrolidin-3-amine
CID 60861984
N-(thiophen-2-ylmethyl)cycloheptanamine
CID 4719997
cyclopropyl-[4-(thiophen-2-ylmethylamino)piperidin-1-yl]methanone
CID 43434770
4-(thiophen-2-ylmethylamino)cyclohexan-1-ol
CID 43178546
4-fluoro-N-(thiophen-2-ylmethyl)cyclohexan-1-amine
CID 130678026
cis-(1R,3S)-3-methyl-N-(thiophen-2-ylmethyl)cyclopentan-1-amine
CID 95376419
N-benzyl-1-(cyclopentylmethyl)piperidin-3-amine
CID 83993970
tert-butyl 4-(thiophen-2-ylmethylamino)piperidine-1-carboxylate
CID 43652164

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine?
The IUPAC name of 1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine (CID 115618481) is 1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine.
What is the SMILES notation for 1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine?
The canonical SMILES for 1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine is c1csc(CNC2CCN(CC3CC3)C2)c1.
What is the InChIKey of 1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine?
The InChIKey is DUWUMXRODZACGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2S/c1-2-13(16-7-1)8-14-12-5-6-15(10-12)9-11-3-4-11/h1-2,7,11-12,14H,3-6,8-10H2.
What are the key properties of 1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine?
1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine has a molecular weight of 236.38 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine is sourced from PubChem (CID 115618481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).