[5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol

C12H19N3O — CID 107372763

IUPAC[5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol
SMILESCCCN(CC1CC1)c1cnc(CO)cn1
InChIInChI=1S/C12H19N3O/c1-2-5-15(8-10-3-4-10)12-7-13-11(9-16)6-14-12/h6-7,10,16H,2-5,8-9H2,1H3
InChIKeyNHEIUAVPPRZYBM-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.60
Rot. Bonds6

About [5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol

[5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol (PubChem CID 107372763) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is [5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol.

Molecular Properties

Compound Name[5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol
PubChem CID107372763
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol
SMILESCCCN(CC1CC1)c1cnc(CO)cn1
InChIInChI=1S/C12H19N3O/c1-2-5-15(8-10-3-4-10)12-7-13-11(9-16)6-14-12/h6-7,10,16H,2-5,8-9H2,1H3
InChIKeyNHEIUAVPPRZYBM-UHFFFAOYSA-N
XLogP1.60
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(chloromethyl)-N-(cyclopropylmethyl)-N-propylpyrazin-2-amine
CID 107373395
[5-[2-(dimethylamino)ethyl-propylamino]pyrazin-2-yl]methanol
CID 107372809
[2-[cyclopropylmethyl(propyl)amino]-4-pyridinyl]methanol
CID 61445364
5-(chloromethyl)-N-(cyclopropylmethyl)-N-propylpyridin-2-amine
CID 61445168
5-chloro-N-(cyclopropylmethyl)-4-(ethylaminomethyl)-N-propylpyridin-2-amine
CID 114925867
[6-[cyclopropylmethyl(ethyl)amino]pyrazin-2-yl]methanol
CID 66466162
2-N-(cyclopropylmethyl)-2-N-propylpyrimidine-2,5-diamine
CID 61146606
6-chloro-N-(cyclopropylmethyl)-N-propylpyridin-2-amine
CID 63587069
6-[(tert-butylamino)methyl]-N-(cyclopropylmethyl)-N-propylpyrazin-2-amine
CID 66457459
[5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol
CID 107372760
N-(cyclopropylmethyl)-5-(propylaminomethyl)-N-prop-2-ynylpyrazin-2-amine
CID 107380630
4-(chloromethyl)-N-(cyclopropylmethyl)-N,6-dipropylpyridin-2-amine
CID 113380688

Frequently Asked Questions

What is the IUPAC name of [5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol?
The IUPAC name of [5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol (CID 107372763) is [5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol.
What is the SMILES notation for [5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol?
The canonical SMILES for [5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol is CCCN(CC1CC1)c1cnc(CO)cn1.
What is the InChIKey of [5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol?
The InChIKey is NHEIUAVPPRZYBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-2-5-15(8-10-3-4-10)12-7-13-11(9-16)6-14-12/h6-7,10,16H,2-5,8-9H2,1H3.
What are the key properties of [5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol?
[5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol has a molecular weight of 221.30 g/mol, XLogP of 1.60, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[cyclopropylmethyl(propyl)amino]pyrazin-2-yl]methanol is sourced from PubChem (CID 107372763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).