3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine

C17H18F2N2 — CID 138115553

IUPAC3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine
SMILESCN(C)CCCn1c2ccccc2c2c(F)cc(F)cc21
InChIInChI=1S/C17H18F2N2/c1-20(2)8-5-9-21-15-7-4-3-6-13(15)17-14(19)10-12(18)11-16(17)21/h3-4,6-7,10-11H,5,8-9H2,1-2H3
InChIKeyWUOKEXMRPXUDFU-UHFFFAOYSA-N
MW288.34 g/mol
LogP4.02
Rot. Bonds4

About 3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine

3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine (PubChem CID 138115553) has the molecular formula C17H18F2N2 and a molecular weight of 288.34 g/mol. Its IUPAC name is 3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine
PubChem CID138115553
Molecular FormulaC17H18F2N2
Molecular Weight288.34 g/mol
Exact Mass288.14
IUPAC Name3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine
SMILESCN(C)CCCn1c2ccccc2c2c(F)cc(F)cc21
InChIInChI=1S/C17H18F2N2/c1-20(2)8-5-9-21-15-7-4-3-6-13(15)17-14(19)10-12(18)11-16(17)21/h3-4,6-7,10-11H,5,8-9H2,1-2H3
InChIKeyWUOKEXMRPXUDFU-UHFFFAOYSA-N
XLogP4.02
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.34
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethyl-3-(3-nitrocarbazol-9-yl)propan-1-amine
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10-chloro-5-[3-(dimethylamino)propyl]-7H-indolo[2,3-c]quinolin-6-one
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3-(1,3-dimethylpyrido[3,4-b]indol-9-yl)-N,N-dimethylpropan-1-amine
CID 1403670
3-(3-ethylidene-2-methylideneindol-1-yl)-N,N-dimethylpropan-1-amine
CID 91345374
10-[2-(dimethylamino)ethyl]acridin-9-one
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1-[3-(dimethylamino)propyl]indol-3-amine
CID 70997307
4-[3-(dimethylamino)propyl]-2-methyl-1H-pyrrolo[3,4-b]indol-3-one
CID 97356822
5-[3-(dimethylamino)propyl]thieno[3,2-c]quinolin-4-one
CID 1211818
1-[[9-[3-(dimethylamino)propyl]carbazol-3-yl]methyl]piperidin-3-amine
CID 67996165
3-[3-(dimethylamino)propyl]-23-methyl-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4,6,8,10,15,17,19,21-nonaen-12-one
CID 67874484
3-(2,7-dimethoxycarbazol-9-yl)-N,N-dimethylpropan-1-amine
CID 58544929
[9-[3-(dimethylamino)propyl]carbazol-2-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-2-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-2-yl]-[4-(2-phenylethyl)piperazin-1-yl]methanone
CID 158193911

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine (CID 138115553) is 3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine is CN(C)CCCn1c2ccccc2c2c(F)cc(F)cc21.
What is the InChIKey of 3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine?
The InChIKey is WUOKEXMRPXUDFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F2N2/c1-20(2)8-5-9-21-15-7-4-3-6-13(15)17-14(19)10-12(18)11-16(17)21/h3-4,6-7,10-11H,5,8-9H2,1-2H3.
What are the key properties of 3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine?
3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine has a molecular weight of 288.34 g/mol, XLogP of 4.02, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-difluorocarbazol-9-yl)-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 138115553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).