N-(2-chlorophenyl)pyrrolidin-3-amine

C10H13ClN2 — CID 66545622

IUPACN-(2-chlorophenyl)pyrrolidin-3-amine
SMILESClc1ccccc1NC1CCNC1
InChIInChI=1S/C10H13ClN2/c11-9-3-1-2-4-10(9)13-8-5-6-12-7-8/h1-4,8,12-13H,5-7H2
InChIKeyRBKLGDQJANQNBY-UHFFFAOYSA-N
MW196.68 g/mol
LogP2.11
Rot. Bonds2

About N-(2-chlorophenyl)pyrrolidin-3-amine

N-(2-chlorophenyl)pyrrolidin-3-amine (PubChem CID 66545622) has the molecular formula C10H13ClN2 and a molecular weight of 196.68 g/mol. Its IUPAC name is N-(2-chlorophenyl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN-(2-chlorophenyl)pyrrolidin-3-amine
PubChem CID66545622
Molecular FormulaC10H13ClN2
Molecular Weight196.68 g/mol
Exact Mass196.08
IUPAC NameN-(2-chlorophenyl)pyrrolidin-3-amine
SMILESClc1ccccc1NC1CCNC1
InChIInChI=1S/C10H13ClN2/c11-9-3-1-2-4-10(9)13-8-5-6-12-7-8/h1-4,8,12-13H,5-7H2
InChIKeyRBKLGDQJANQNBY-UHFFFAOYSA-N
XLogP2.11
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.68
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-2-N,2-N-dimethyl-1-N-pyrrolidin-3-ylbenzene-1,2-diamine
CID 79730840
N-(2-bromophenyl)pyrrolidin-3-amine
CID 66545624
N-(2-methylphenyl)pyrrolidin-3-amine
CID 79725314
N-(2-chloro-4-methylphenyl)pyrrolidin-3-amine
CID 79724113
N-[2-chloro-4-(fluoromethyl)phenyl]pyrrolidin-3-amine
CID 115036943
N-(2-ethylsulfanylphenyl)pyrrolidin-3-amine
CID 79731060
4-N-(2-chlorophenyl)-1-N-methylcyclohexane-1,4-diamine
CID 117027455
2-(3,4-dichlorophenyl)-N-pyrrolidin-3-ylpyridin-3-amine
CID 66657206
1-(2-chlorophenyl)-3-[(3R)-piperidin-3-yl]urea
CID 113436699
N-[(2-chlorophenyl)methyl]pyrrolidin-3-amine;hydrochloride
CID 66519955
N-pyrrolidin-3-yl-1H-pyrrol-2-amine
CID 115118615
2-[2-(pyrrolidin-3-ylamino)phenyl]acetamide
CID 79731342

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)pyrrolidin-3-amine?
The IUPAC name of N-(2-chlorophenyl)pyrrolidin-3-amine (CID 66545622) is N-(2-chlorophenyl)pyrrolidin-3-amine.
What is the SMILES notation for N-(2-chlorophenyl)pyrrolidin-3-amine?
The canonical SMILES for N-(2-chlorophenyl)pyrrolidin-3-amine is Clc1ccccc1NC1CCNC1.
What is the InChIKey of N-(2-chlorophenyl)pyrrolidin-3-amine?
The InChIKey is RBKLGDQJANQNBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2/c11-9-3-1-2-4-10(9)13-8-5-6-12-7-8/h1-4,8,12-13H,5-7H2.
What are the key properties of N-(2-chlorophenyl)pyrrolidin-3-amine?
N-(2-chlorophenyl)pyrrolidin-3-amine has a molecular weight of 196.68 g/mol, XLogP of 2.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)pyrrolidin-3-amine is sourced from PubChem (CID 66545622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).