N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine

C14H19N3 — CID 115244510

IUPACN-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine
SMILESCNCC1(CNc2c[nH]c3ccccc23)CC1
InChIInChI=1S/C14H19N3/c1-15-9-14(6-7-14)10-17-13-8-16-12-5-3-2-4-11(12)13/h2-5,8,15-17H,6-7,9-10H2,1H3
InChIKeyNFSSRJMYMAVAHN-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.58
Rot. Bonds5

About N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine

N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine (PubChem CID 115244510) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine.

Molecular Properties

Compound NameN-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine
PubChem CID115244510
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC NameN-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine
SMILESCNCC1(CNc2c[nH]c3ccccc23)CC1
InChIInChI=1S/C14H19N3/c1-15-9-14(6-7-14)10-17-13-8-16-12-5-3-2-4-11(12)13/h2-5,8,15-17H,6-7,9-10H2,1H3
InChIKeyNFSSRJMYMAVAHN-UHFFFAOYSA-N
XLogP2.58
TPSA39.85 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(1H-indol-3-yl)-N-methylbutane-1,4-diamine
CID 115201685
N'-(1H-indol-3-yl)-N-methylethane-1,2-diamine
CID 115195726
N-ethyl-1H-indol-3-amine
CID 22497863
N'-(1H-indol-3-yl)methanediamine
CID 115225408
N-prop-2-ynyl-1H-indol-3-amine
CID 57486159
N-(azetidin-3-ylmethyl)-1H-indol-3-amine
CID 115207247
1-N-(1H-indol-3-yl)-3-methylbutane-1,3-diamine
CID 115200367
1H-indol-3-yl-[1-(methylaminomethyl)cyclopropyl]methanone
CID 116921378
N-(2-methylbutyl)-1H-indol-3-amine
CID 175206983
N-(1H-indol-3-yl)-N'-propan-2-ylethane-1,2-diamine
CID 115206245
1-N-(1H-indol-3-yl)butane-1,3-diamine
CID 115199018
N-[2-(1H-indol-3-yl)ethyl]-1H-indol-3-amine
CID 91539379

Frequently Asked Questions

What is the IUPAC name of N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine?
The IUPAC name of N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine (CID 115244510) is N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine.
What is the SMILES notation for N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine?
The canonical SMILES for N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine is CNCC1(CNc2c[nH]c3ccccc23)CC1.
What is the InChIKey of N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine?
The InChIKey is NFSSRJMYMAVAHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-15-9-14(6-7-14)10-17-13-8-16-12-5-3-2-4-11(12)13/h2-5,8,15-17H,6-7,9-10H2,1H3.
What are the key properties of N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine?
N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine has a molecular weight of 229.33 g/mol, XLogP of 2.58, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-indol-3-amine is sourced from PubChem (CID 115244510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).